UCSF

ZINC33826783

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 28th, 2009 21 Yes

Popular Name: 2H-1,4-Benzoxazin-3(4H)-one, 6-chloro-2-methyl-4-(2-(4-morpholinyl)ethyl)-, monohydrochloride; 6-Chloro-2-methyl-4-(2-(4-morpholinyl)ethyl)-2H-1,4-benzoxazin-3(4H)-one monohydrochloride; LS-41843 2H-1,4-Benzoxazin-3(4H)-one, 6-c…

Find On: PubMed — Wikipedia — Google

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.12 4.12 -6.44 0 5 0 42 310.781 3 ↓
Mid Mid (pH 6-8) 2.12 6.38 -39.2 1 5 1 43 311.789 3 ↓

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )